5-ethyl-2,4-dimethylpyridazin-3-one

C8H12N2O — CID 170978400

IUPAC5-ethyl-2,4-dimethylpyridazin-3-one
SMILESCCc1cnn(C)c(=O)c1C
InChIInChI=1S/C8H12N2O/c1-4-7-5-9-10(3)8(11)6(7)2/h5H,4H2,1-3H3
InChIKeyDHGRITMEQFKZHZ-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.65
Rot. Bonds1

About 5-ethyl-2,4-dimethylpyridazin-3-one

5-ethyl-2,4-dimethylpyridazin-3-one (PubChem CID 170978400) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 5-ethyl-2,4-dimethylpyridazin-3-one.

Molecular Properties

Compound Name5-ethyl-2,4-dimethylpyridazin-3-one
PubChem CID170978400
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name5-ethyl-2,4-dimethylpyridazin-3-one
SMILESCCc1cnn(C)c(=O)c1C
InChIInChI=1S/C8H12N2O/c1-4-7-5-9-10(3)8(11)6(7)2/h5H,4H2,1-3H3
InChIKeyDHGRITMEQFKZHZ-UHFFFAOYSA-N
XLogP0.65
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-Dimethyl-5-(trifluoromethyl)pyridazin-3-one;ethane
CID 142521690
2-Methyl-4-propan-2-yl-5-(trifluoromethyl)pyridazin-3-one
CID 170587438
4-Fluoro-2-methyl-5-propan-2-ylpyridazin-3-one
CID 172614337
6-Fluoro-2,4-dimethyl-5-propan-2-ylpyridazin-3-one
CID 172614414
2,6,7-Trimethyl-5,8-dihydrophthalazin-1-one
CID 11030602
2-Methyl-5-propan-2-ylpyridazin-3-one
CID 12864814
5-Chloro-2,4-diethylpyridazin-3-one
CID 13825166
2,4,5,6-Tetramethylpyridazin-3-one
CID 18683336
2,4,5-Trimethylpyridazin-3-one
CID 20669839
2-Butyl-4,5-ditert-butylpyridazin-3-one
CID 20872023
4,5-Ditert-butyl-2-methylpyridazin-3-one
CID 20872054
4,5-Ditert-butyl-2-propylpyridazin-3-one
CID 23552383

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2,4-dimethylpyridazin-3-one?
The IUPAC name of 5-ethyl-2,4-dimethylpyridazin-3-one (CID 170978400) is 5-ethyl-2,4-dimethylpyridazin-3-one.
What is the SMILES notation for 5-ethyl-2,4-dimethylpyridazin-3-one?
The canonical SMILES for 5-ethyl-2,4-dimethylpyridazin-3-one is CCc1cnn(C)c(=O)c1C.
What is the InChIKey of 5-ethyl-2,4-dimethylpyridazin-3-one?
The InChIKey is DHGRITMEQFKZHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-4-7-5-9-10(3)8(11)6(7)2/h5H,4H2,1-3H3.
What are the key properties of 5-ethyl-2,4-dimethylpyridazin-3-one?
5-ethyl-2,4-dimethylpyridazin-3-one has a molecular weight of 152.20 g/mol, XLogP of 0.65, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2,4-dimethylpyridazin-3-one is sourced from PubChem (CID 170978400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).